SCHEMBL15420404

SCHEMBL15420404

CCS(=O)(=O)N[C@H]1COCC[C@@H]1COc1ccc(-c2ccc(F)cn2)cc1

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GRIA2 P42262 5/20 0.48
GRM5 P41594 5/20 0.37
XDH P47989 1/20 0.36
KDM4E B2RXH2 2/20 0.33
ALDH1A1 P00352 2/20 0.33
HPGD P15428 2/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
HTT P42858 1/20 0.33
HDAC1 Q13547 1/20 0.32
HDAC2 Q92769 1/20 0.32
KCNH2 Q12809 1/20 0.32
GPR183 P32249 1/20 0.32
GPR119 Q8TDV5 1/20 0.32
MAPT P10636 1/20 0.32
RAB9A P51151 1/20 0.32
MCHR1 Q99705 1/20 0.32
GRM4 Q14833 2/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL15441034 0.93 GRIA2 (0.46) GRIA2GRM5XDHHDAC1HDAC2
SCHEMBL12987133 0.93 GRIA2 (0.46) GRIA2GRM5XDHHDAC1HDAC2
SCHEMBL15420813 0.91 GRIA2 (0.48) GRIA2GRM5XDHHDAC1HDAC2
SCHEMBL12987919 0.89 GRIA2 (0.37) GRIA2XDHKDM4EALDH1A1HPGD
SCHEMBL15420171 0.88 KDM4E (0.47) GRIA2XDHKDM4EALDH1A1HPGD
SCHEMBL15420755 0.87 GRIA2 (0.43) GRIA2GRM5GPR119GRM4
SCHEMBL12987104 0.85 GRM5 (0.36) GRIA2GRM5XDHGRM4
SCHEMBL12987372 0.84 GRIA2 (0.46) GRIA2GRM5XDHHDAC1HDAC2
SCHEMBL15441136 0.84 GRIA2 (0.46) GRIA2GRM5XDHHDAC1HDAC2
SCHEMBL15441176 0.82 CHRNA7 (0.37) GRIA2XDHKDM4EALDH1A1HPGD

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2694472-B1 SULFONAMIDE DERIVATIVE AND USE THEREOF TAKEDA PHARMACEUTICALS CO (JP) 2020-03-11 EP disclosed
US-9527807-B2 Sulfonamide derivative and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2016-12-27 US disclosed
US-9527807-B2 Sulfonamide derivative and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2016-12-27 US disclosed
US-9527807-B2 Sulfonamide derivative and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2016-12-27 US disclosed
US-20140024650-A1 SULFONAMIDE DERIVATIVE AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2014-01-23 US disclosed
US-20140024650-A1 SULFONAMIDE DERIVATIVE AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2014-01-23 US disclosed
US-20140024650-A1 SULFONAMIDE DERIVATIVE AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2014-01-23 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20140024650-A1 SULFONAMIDE DERIVATIVE AND USE THEREOF GRIN2A, GRIN2B, SLC1A2 GRIA2 12/4885GRM5 9/4885XDH 499/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.